(2R)-7-azanyl-7-azanylidene-2-[(1S,2S)-5-(3-methoxyphenyl)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]heptanoate

Systemtic Name: (2R)-7-azanyl-7-azanylidene-2-[(1S,2S)-5-(3-methoxyphenyl)-2-oxidanyl-2,3-dihydro-1H-inden-1-yl]heptanoate Openeye Name: (2R)-7-amino-2-[(1S,2S)-2-hydroxy-5-(3-methoxyphenyl)indan-1-yl]-7-imino-heptanoate CAS Name: (2R)-7-amino-2-[(1S,2S)-2-hydroxy-5-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-yl]-7-iminoheptanoate IUPAC Name: (2R)-7-amino-2-[(1S,2S)-2-hydroxy-5-(3-methoxyphenyl)-2,3-dihydro-1H-inden-1-yl]-7-iminoheptanoate Traditional Name: (2R)-7-amino-2-[(1S,2S)-2-hydroxy-5-(3-methoxyphenyl)indan-1-yl]-7-imino-enanthate Formula: C23H27N2O4- MolecularWeight: 395.47148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC3=C(C=C2)C(C(C3)O)C(CCCCC(=N)N)C(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC3=C(C=C2)[C@@H]([C@H](C3)O)[C@@H](CCCCC(=N)N)C(=O)[O-]

InChI

InChI=1S/C23H28N2O4/c1-29-17-6-4-5-14(12-17)15-9-10-18-16(11-15)13-20(26)22(18)19(23(27)28)7-2-3-8-21(24)25/h4-6,9-12,19-20,22,26H,2-3,7-8,13H2,1H3,(H3,24,25)(H,27,28)/p-1/t19-,20+,22-/m1/s1